N-nona-2,6-dienyl-N-propan-2-ylpropanamide

C15H27NO — CID 76600094

IUPACN-nona-2,6-dienyl-N-propan-2-ylpropanamide
SMILESCCC=CCCC=CCN(C(=O)CC)C(C)C
InChIInChI=1S/C15H27NO/c1-5-7-8-9-10-11-12-13-16(14(3)4)15(17)6-2/h7-8,11-12,14H,5-6,9-10,13H2,1-4H3
InChIKeyKWJPDHQXCCSNFM-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.94
Rot. Bonds8

About N-nona-2,6-dienyl-N-propan-2-ylpropanamide

N-nona-2,6-dienyl-N-propan-2-ylpropanamide (PubChem CID 76600094) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is N-nona-2,6-dienyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-nona-2,6-dienyl-N-propan-2-ylpropanamide
PubChem CID76600094
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC NameN-nona-2,6-dienyl-N-propan-2-ylpropanamide
SMILESCCC=CCCC=CCN(C(=O)CC)C(C)C
InChIInChI=1S/C15H27NO/c1-5-7-8-9-10-11-12-13-16(14(3)4)15(17)6-2/h7-8,11-12,14H,5-6,9-10,13H2,1-4H3
InChIKeyKWJPDHQXCCSNFM-UHFFFAOYSA-N
XLogP3.94
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5-(dimethylamino)-N,N-dimethylhex-2-enamide
CID 44570055
1-Butyryl-1,2,3,6-tetrahydropyridine
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(2S,6S)-1-acetyl-4-methyl-2,6-diprop-2-enyl-1,2,5,6-tetrahydropyridine
CID 726193
1-[2,6-bis(prop-2-enyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
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1,6-Dimethyl-5,6-dihydropyridin-2(1h)-one
CID 12662945
N,N-diisopropylpent-4-enamide
CID 86248502
(3E)-N,N-Diethyl-3-pentenamide
CID 5369259
1-(2,5-Dimethyl-2,5-dihydropyrrol-1-yl)ethanone
CID 23566460
1-Methyl-2-prop-2-enyl-2,3-dihydropyridin-6-one
CID 10511022
(8aS)-6,8a-dihydro-3H-indolizin-5-one
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N-[(E)-hex-4-enyl]-N-prop-1-ynylpent-4-enamide
CID 11218269

Frequently Asked Questions

What is the IUPAC name of N-nona-2,6-dienyl-N-propan-2-ylpropanamide?
The IUPAC name of N-nona-2,6-dienyl-N-propan-2-ylpropanamide (CID 76600094) is N-nona-2,6-dienyl-N-propan-2-ylpropanamide.
What is the SMILES notation for N-nona-2,6-dienyl-N-propan-2-ylpropanamide?
The canonical SMILES for N-nona-2,6-dienyl-N-propan-2-ylpropanamide is CCC=CCCC=CCN(C(=O)CC)C(C)C.
What is the InChIKey of N-nona-2,6-dienyl-N-propan-2-ylpropanamide?
The InChIKey is KWJPDHQXCCSNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-5-7-8-9-10-11-12-13-16(14(3)4)15(17)6-2/h7-8,11-12,14H,5-6,9-10,13H2,1-4H3.
What are the key properties of N-nona-2,6-dienyl-N-propan-2-ylpropanamide?
N-nona-2,6-dienyl-N-propan-2-ylpropanamide has a molecular weight of 237.39 g/mol, XLogP of 3.94, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-nona-2,6-dienyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 76600094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).